2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[2-[(2-methoxyphenyl)methylthio]-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-[2-(o-anisylthio)-1,3-benzothiazol-6-yl]acetamide Formula: C23H22N4O2S3 MolecularWeight: 482.64138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=CC=C4OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=CC=C4OC)C

InChI

InChI=1S/C23H22N4O2S3/c1-14-10-15(2)25-22(24-14)30-13-21(28)26-17-8-9-18-20(11-17)32-23(27-18)31-12-16-6-4-5-7-19(16)29-3/h4-11H,12-13H2,1-3H3,(H,26,28)